179897-95-1 | 4-Bromo-2-chloro-5-methylanisole

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$129.00	$90.00
5g	98%	in stock	$424.00	$297.00
10g	98%	in stock	$712.00	$498.00
25g	98%	in stock	$1,395.00	$977.00
100g	98%	in stock	$3,820.00	$2,674.00

Description

• Catalog Number: AB02642
• Chemical Name: 4-Bromo-2-chloro-5-methylanisole
• CAS Number: 179897-95-1
• Molecular Formula: C8H8BrClO
• Molecular Weight: 235.5055
• MDL Number: MFCD11504949
• SMILES: COc1cc(C)c(cc1Cl)Br

Computed Properties

• Complexity: 131
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 11
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 3.6

Upstream Synthesis Route

The compound 1-Bromo-5-chloro-4-methoxy-2-methylbenzene, also known by its chemical structure C9H9BrClO, plays a crucial role in chemical synthesis as a versatile building block. This compound's unique structure makes it a valuable intermediate in organic synthesis, particularly in the pharmaceutical and agrochemical industries. Its strategic positioning of bromine, chlorine, methoxy, and methyl functional groups allows for various synthetic transformations to be carried out effectively.1-Bromo-5-chloro-4-methoxy-2-methylbenzene is commonly used in the preparation of more complex molecules due to its ability to participate in multiple types of chemical reactions, such as nucleophilic substitution and transition metal-catalyzed cross-coupling reactions. These reactions enable the selective modification of the compound, leading to the creation of diverse chemical entities with specific properties and functions.In pharmaceutical synthesis, this compound can serve as a key starting material for the preparation of biologically active compounds, including potential drug candidates. Its structural features provide opportunities for the introduction of functional groups that are essential for enhancing the desired pharmacological activity and improving the overall drug properties.Furthermore, in agrochemical synthesis, 1-Bromo-5-chloro-4-methoxy-2-methylbenzene can be utilized for the construction of molecules with pesticidal or herbicidal properties. By incorporating this compound into the synthesis of agrochemical products, researchers can design compounds with targeted activities against pests or unwanted plant species while maintaining environmental sustainability.Overall, the application of 1-Bromo-5-chloro-4-methoxy-2-methylbenzene in chemical synthesis showcases its importance as a valuable building block for the construction of diverse organic molecules with therapeutic or agricultural significance.